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ChemicalBook--->CAS DataBase List--->1072-84-0

1072-84-0

1072-84-0 Structure

1072-84-0 Structure
IdentificationMore
[Name]

1H-Imidazole-4-carboxylic acid
[CAS]

1072-84-0
[Synonyms]

1H-IMIDAZOLE-4-CARBOXYLIC ACID
4(5)-IMIDAZOLECARBOXYLIC ACID
4-IMIDAZOLECARBOXYLIC ACID
IMIDAZOLE-4-CARBOXYLIC ACID
RARECHEM AL BE 0762
4-carboxyimidazole
4-hydroxy imizodale
Imidazol-4-carboxylic acid
1H-Imidazole-5-carboxylic acid 98%
[EINECS(EC#)]

214-017-8
[Molecular Formula]

C4H4N2O2
[MDL Number]

MFCD00082203
[Molecular Weight]

112.09
[MOL File]

1072-84-0.mol
Chemical PropertiesBack Directory
[Appearance]

Gray or tan powder
[Melting point ]

294-295 °C (lit.)
[Boiling point ]

495.0±18.0 °C(Predicted)
[density ]

1.524±0.06 g/cm3(Predicted)
[storage temp. ]

Refrigerator
[solubility ]

Aqueous Acid (sparingly)
[form ]

Liquid
[pka]

2.69±0.10(Predicted)
[color ]

Clear colorless
[InChI]

InChI=1S/C4H4N2O2/c7-4(8)3-1-5-2-6-3/h1-2H,(H,5,6)(H,7,8)
[InChIKey]

NKWCGTOZTHZDHB-UHFFFAOYSA-N
[SMILES]

C1NC(C(O)=O)=CN=1
[CAS DataBase Reference]

1072-84-0(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[RTECS ]

NI4001000
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29332900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sulfuric acid-->Acetic anhydride-->Triethyl orthoformate-->Anisole-->4,5-Imidazoledicarboxylic acid-->Diaminomaleonitrile
[Preparation Products]

1-Trityl-1H-imidazole-4-carboxylic acid-->Imidazole-4-methanol
Hazard InformationBack Directory
[Chemical Properties]

Gray or tan powder
[Uses]

4-Imidazolecarboxylic acid (ICA) was used in the synthesis of triphenymethyl-protected 4-imidazole carboxylic acid (trityl-ImCOOH) which is employed to functionalize poly(propylene imine) dendrimers.
It may be used in the following studies:
  • In the synthesis of lanthanide sulfate–carboxylates, [Ln(HIMC)(SO4)(H2O)] (Ln = Dy and Eu, HIMC = 4-imidazolecarboxylic acid) by in situ decarboxylation in the presence of Cu(II) ions.
  • As an internal standard to obtain calibration curve by plotting the peak area ratios of histamine (HA) and several metabolites isolated from C3H/HeNCrj mice hair relative to ICA.
  • In the synthesis of tetranuclear manganese carboxylate complexes possessing imidazole-based N/O chelating ligands.
[General Description]

4-Imidazolecarboxylic acid (1H-imidazole-4-carboxylic acid, H2imc) is an imidazole derivative that contains an imidazole group and a carboxylate group. It has been widely utilized to generate different types of coordination polymers. The anion of 4-imidazolecarboxylic acid has been reported to stabilize binuclear hydroxo complexes of trivalent lanthanides in the pH range 7-10.
Spectrum DetailBack Directory
[Spectrum Detail]

1H-Imidazole-4-carboxylic acid(1072-84-0)MS
1H-Imidazole-4-carboxylic acid(1072-84-0)1HNMR
1H-Imidazole-4-carboxylic acid(1072-84-0)IR1
1H-Imidazole-4-carboxylic acid(1072-84-0)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1H-Imidazole-4-carboxylic acid, 98%(1072-84-0)
[Sigma Aldrich]

1072-84-0(sigmaaldrich)
[TCI AMERICA]

4-Imidazolecarboxylic Acid,>98.0%(LC)(1072-84-0)
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